| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 18th, 2008 | 31 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.68 | 9.23 | -72.91 | 1 | 8 | 0 | 96 | 426.469 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.68 | 6.65 | -60.65 | 0 | 8 | -1 | 95 | 425.461 | 9 | ↓ |
| Hi High (pH 8-9.5) | 1.68 | 5.93 | -46.31 | 0 | 8 | -1 | 95 | 425.461 | 8 | ↓ |
